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A Karplus Equation for the Conformational Analysis of Organic Molecular Crystals

Pierre Thureau1, Isaure Carvin1, Fabio Ziarelli2

  • 1Aix Marseille Univ, CNRS, ICR UMR 7273, Marseille, France.

Angewandte Chemie (International Ed. in English)
|August 10, 2019
PubMed

Keywords:
NMR spectroscopydensity functional calculationssolid-state structuresstructure elucidationtorsional angles

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